Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 5/20 | 0.54 |
| ▸ | ACP3 | P15309 | 1/20 | 0.40 |
| ▸ | TACR1 | P25103 | 2/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.39 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.39 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | GRM8 | O00222 | 1/20 | 0.38 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL3637472 | 0.87 | CYP19A1 (0.44) | CYP19A1CNR2EPHX2 | |
| SCHEMBL23960430 | 0.82 | CYP19A1 (0.54) | CYP19A1TACR1PAX8GRM8GRM4 | |
| SCHEMBL6699187 | 0.81 | CYP19A1 (0.49) | CYP19A1CNR2 | |
| SCHEMBL4441835 | 0.80 | CACNA1A (0.48) | AKR1C3AKR1C2SLC6A9CNR2 | |
| SCHEMBL11800229 | 0.79 | CYP19A1 (0.51) | CYP19A1TACR1 | |
| SCHEMBL23960436 | 0.77 | CYP19A1 (0.46) | CYP19A1ACP3TACR1AKR1C3AKR1C2 | |
| SCHEMBL4434646 | 0.77 | AKR1C3 (0.45) | CYP19A1AKR1C3AKR1C2 | |
| SCHEMBL8233890 | 0.77 | ACP3 (0.47) | CYP19A1ACP3AKR1C3AKR1C2HSD11B1 | |
| SCHEMBL4433951 | 0.76 | AKR1C3 (0.50) | CYP19A1AKR1C3AKR1C2 | |
| SCHEMBL13285842 | 0.76 | HSD11B1 (0.49) | CYP19A1ACP3HSD11B1CES2CES1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021214048-A1 | DUAL INHIBITORS OF SOLUBLE EPOXIDE HYDROLASE AND 5-LIPOXYGENASE | Johann Wolfgang Goethe-Universität Frankfurt am Main (DE) | 2021-10-28 | — | — | WO | disclosed |